In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 19 | Yes |
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 3.79 | 6.32 | -6.45 | 1 | 3 | 0 | 34 | 256.349 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.79 | 6.81 | -29.24 | 2 | 3 | 1 | 35 | 257.357 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.